(4-bromophenyl)methyl 4-chloranyl-1,5-dimethyl-pyrazole-3-carboxylate

Systemtic Name: (4-bromophenyl)methyl 4-chloranyl-1,5-dimethyl-pyrazole-3-carboxylate Openeye Name: (4-bromophenyl)methyl 4-chloro-1,5-dimethyl-pyrazole-3-carboxylate CAS Name: 4-chloro-1,5-dimethyl-3-pyrazolecarboxylic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 4-chloro-1,5-dimethylpyrazole-3-carboxylate Traditional Name: 4-chloro-1,5-dimethyl-pyrazole-3-carboxylic acid (4-bromobenzyl) ester Formula: C13H12BrClN2O2 MolecularWeight: 343.60358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C(=O)OCC2=CC=C(C=C2)Br)Cl

Isomeric SMILES

CC1=C(C(=NN1C)C(=O)OCC2=CC=C(C=C2)Br)Cl

InChI

InChI=1S/C13H12BrClN2O2/c1-8-11(15)12(16-17(8)2)13(18)19-7-9-3-5-10(14)6-4-9/h3-6H,7H2,1-2H3